Thymol acetate
Also known as Thymyl acetate, Acetylthymol, O-Acetylthymol
Key facts
What buyers check first
- CAS number
- 528-79-0
- Formula
- C12H16O2
- Molar mass
- 192.26 g/mol
- EC number
- 208-442-8
- HS code
- 291539
- Category
- Synthetic aroma chemicals
What is Thymol acetate?
Plain description, key identifiers and synonyms
Thymyl acetate is a monoterpenoid.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (5-methyl-2-propan-2-ylphenyl) acetate
- CAS number
- 528-79-0 CAS number cross-checked
- EC number
- 208-442-8
- Molecular formula
- C12H16O2
- UNII
- 6I29126I5V
- MDL number
- MFCD02149365
- INCI name
- THYMOL ACETATE
- InChIKey
- WFMIUXMJJBBOGJ-UHFFFAOYSA-N
- InChI
- InChI=1S/C12H16O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h5-8H,1-4H3
- SMILES (canonical and isomeric)
- CC1=CC(=C(C=C1)C(C)C)OC(=O)C
Synonyms
- Thymyl acetate
- Acetylthymol
- O-Acetylthymol
- Acetyl thymol
- Phenol, 5-methyl-2-(1-methylethyl)-, acetate
- Phenol, 5-methyl-2-(1-methylethyl)-, 1-acetate
- (2-isopropyl-5-methyl-phenyl) acetate
- Thymol, acetate
- (5-methyl-2-propan-2-ylphenyl) acetate
- 5-methyl-2-(propan-2-yl)phenyl acetate
- 2-Isopropyl-5-methylphenol acetate
- Thymol derivative, 17
- 2-Isopropyl-5-methylphenyl acetate #
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 192.26 g/molcalc.Computed value |
|---|---|
| Exact mass | 192.115 Dacalc.Computed value |
| LogP (octanol/water) | 3.04calc.Computed value |
| Topological polar surface area | 26.3 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 2calc.Computed value |
| Rotatable bonds | 2calc.Computed value |
| Heavy atoms | 14calc.Computed value |
| Rings | 1calc.Computed value |
| Aromatic rings | 1calc.Computed value |
| Fraction sp3 carbons | 0.42calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Thymol acetate suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- United States, Los AngelesUnclaimed profileThymol acetateGrade, purity and minimum order on requestPrice on request
Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.
Where suppliers are based
1 supplier in 1 country
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Thymol acetate price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Industries and functions
Cosmetic ingredient, INCI name THYMOL ACETATE(perfuming)
Functional uses
- Flavouring and nutrient
- Fragrance
Cosmetic functions
- Perfuming
Regulatory status
Inventories, regulations and trade controls that list this substance
Health and food
- EU cosmetic ingredient inventory
United States
- TSCA inventory (USA)Status: Inactive in US commerce
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Thymol acetate is traded under.
Esters of acetic acid, other
- China58.0%
- United States7.3%
- Germany6.5%
- Singapore15.6%
- South Korea7.2%
- Indonesia6.9%
The HS code shown for Thymol acetate is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Thymol acetate, based on the data on this page
What is Thymol acetate?
What is the CAS number of Thymol acetate?
What is the molecular formula and weight of Thymol acetate?
What is Thymol acetate used for?
Is Thymol acetate hazardous?
What is the HS code of Thymol acetate?
Where can I buy Thymol acetate?
What is the price of Thymol acetate?
Guides for buyers
Practical guides that help when you source, ship or handle Thymol acetate
- Article, FormulationHow to choose a cosmetic emulsifierA structured way to choose an emulsifier for creams and lotions: emulsion type, HLB and its limits, emulsifier families, formula fit, stability testing and what to ask suppliers.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
- Guide, Trade and logisticsHS codes for chemicals and why they matterHow the Harmonized System classifies chemicals, the chapters that matter, the rules for chemically defined compounds and mixtures, and practical steps to find the right code.Read
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